Produkty 36450-01-8

CAS 36450-01-8 to numer rejestracyjny substancji 6β-Hydroxystigmasta-4,22-dien-3-one. Oferty producentów: MedChemExpress. Dostępne opakowania: Get quote.

6β-Hydroxystigmasta-4,22-dien-3-one
MedChemExpress
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Wzór strukturalny: {0} (CAS {1})

(6R,8S,9S,10R,13R,14S,17R)-17-[(E,2R,5S)-5-ethyl-6-methylhept-3-en-2-yl]-6-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one (CAS 36450-01-8) to związek chemiczny o wzorze sumarycznym C29H46O2 i masie molowej 426.7 g/mol. Nazwa systematyczna IUPAC: (6R,8S,9S,10R,13R,14S,17R)-17-[(E,2R,5S)-5-ethyl-6-methylhept-3-en-2-yl]-6-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one. InChIKey: FFKIQLXJMQUBQZ-IRLJAPRMSA-N.

Dane identyfikacyjne
Wzór sumarycznyC29H46O2
Masa molowa426.7 g/mol
Nazwa IUPAC(6R,8S,9S,10R,13R,14S,17R)-17-[(E,2R,5S)-5-ethyl-6-methylhept-3-en-2-yl]-6-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
InChIKeyFFKIQLXJMQUBQZ-IRLJAPRMSA-N
SMILESCC[C@H](/C=C/[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H](C4=CC(=O)CC[C@]34C)O)C)C(C)C

Dane obliczone przez PubChem (NCBI)

Synonimy: 6-Hydroxystigmasta-4,22-dien-3-one, 6|A-Hydroxystigmasta-4,22-dien-3-one, orb1941512, orb1991765, 6|?-Hydroxystigmasta-4,22-dien-3-one, Stigmasta-4,22-dien-6.beta.-ol-3-one, Stigmasta-4,22-dien-6I(2)-ol-3-one, (22E)-6beta-Hydroxystigmasta-4,22-dien-3-one
Izomery (ten sam wzór sumaryczny)
[(3S,9S,10R,13R,14R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate C29H46O2
(3R,3aS,5aR,5bR,7R,7aR,9S,11aR,11bR,13aR,13bS)-5a,5b,11a,13b-tetramethyl-8-methylidene-3-prop-1-en-2-yl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysene-7,9-diol C29H46O2
[(3R,8S,9S,10R,13S,14S,17R)-10,13-dimethyl-17-[(Z)-6-methylhept-2-en-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate C29H46O2
(8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,6-dione C29H46O2
(8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,4,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,7-dione C29H46O2

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